SCHEMBL8415149

SCHEMBL8415149

CC(C)c1nccc(N)c1Cl

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 3/20 0.36
SOS2 Q07890 1/20 0.36
TDO2 P48775 1/20 0.35
GAA P10253 1/20 0.34
POLB P06746 2/20 0.33
IMPDH2 P12268 1/20 0.32
NCF1 P14598 1/20 0.32
NOS3 P29474 3/20 0.30
NOS2 P35228 3/20 0.30
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
NOS1 P29475 1/20 0.30
KMT2A Q03164 1/20 0.30
G6PD P11413 1/20 0.30
RET P07949 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL15740563 0.78 NOS3 (0.37) NR4A2SOS2TDO2NCF1NOS3
SCHEMBL24848738 0.78 CYP1A2 (0.33) TDO2
SCHEMBL20285918 0.77 CCR1 (0.37) TDO2NOS3NOS2RET
SCHEMBL19769057 0.75 TDO2 (0.37) NR4A2TDO2GAAPOLBNOS3
SCHEMBL19629678 0.72 FGFR2 (0.36) KDM4EKMT2AG6PD
SCHEMBL31317485 0.72
SCHEMBL25278358 0.72
SCHEMBL4405300 0.71
SCHEMBL13085735 0.71 NOS3 (0.43) NR4A2NOS3NOS2KDM4EMEN1
SCHEMBL30211301 0.71 NOS3 (0.43) NR4A2NOS3NOS2KDM4EMEN1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150361095-A1 PHOSPHATIDYLINOSITOL 3-KINASE INHIBITORS GILEAD SCIENCES, INC. 2015-12-17 US disclosed
US-5877322-A Substituted pyridines, their preparation, and their use as pesticides and fungicides HOECHST SCHERING AGREVO GMBH (DE) 1999-03-02 US disclosed
US-5723450-A Substituted pyridines, their preparation, and their use as pesticides and fungicides HOECHST SCHERING AGREVO GMBH (DE) 1998-03-03 US disclosed
CN-1130900-A Substituted pyridines, their preparation and their use as pesticides and fungicides HOECHST SCHERING AGREVO GMBH (DE) 1996-09-11 CN disclosed
CN-1130901-A Substituted pyridines, their preparation and their use as pesticides and fungicides HOECHST SCHERING AGREVO GMBH (DE) 1996-09-11 CN disclosed
EP-0719256-A1 SUBSTITUTED PYRIDINES, PROCESS FOR PRODUCING THEM AND THEIR USE AS PESTICIDES AND FUNGICIDES Hoechst Schering AgrEvo GmbH (DE) 1996-07-03 EP disclosed
EP-0719257-A1 SUBSTITUTED PYRIDINES, PROCESS FOR PRODUCING THEM AND THEIR USE AS PESTICIDES AND FUNGICIDES Hoechst Schering AgrEvo GmbH (DE) 1996-07-03 EP disclosed
WO-1995007891-A1 SUBSTITUTED PYRIDINES, PROCESS FOR PRODUCING THEM AND THEIR USE AS PESTICIDES AND FUNGICIDES HOECHST SCHERING AGREVO GMBH (DE) 1995-03-23 WO disclosed
WO-1995007892-A1 SUBSTITUTED PYRIDINES, PROCESS FOR PRODUCING THEM AND THEIR USE AS PESTICIDES AND FUNGICIDES HOECHST SCHERING AGREVO GMBH (DE) 1995-03-23 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20150361095-A1 PHOSPHATIDYLINOSITOL 3-KINASE INHIBITORS PIK3CA, AKT3, PIK3CD NR4A2 3971/4885SOS2 3455/4885TDO2 3134/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.